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17714-06-6

17714-06-6 | 2,4-Pteridinediamine, 6-chloro-

CAS No: 17714-06-6 Catalog No: AG00254I MDL No:MFCD20527976

Product Description

Catalog Number:
AG00254I
Chemical Name:
2,4-Pteridinediamine, 6-chloro-
CAS Number:
17714-06-6
Molecular Formula:
C6H5ClN6
Molecular Weight:
196.5971
MDL Number:
MFCD20527976
IUPAC Name:
6-chloropteridine-2,4-diamine
InChI:
InChI=1S/C6H5ClN6/c7-2-1-10-5-3(11-2)4(8)12-6(9)13-5/h1H,(H4,8,9,10,12,13)
InChI Key:
OTYIEMDMJHKNBP-UHFFFAOYSA-N
SMILES:
Clc1cnc2c(n1)c(N)nc(n2)N

Properties

Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.026g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.598g/mol
Monoisotopic Mass:
196.026g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

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